MolNFT v1 · #166029 · protein

Crystal structure of a putative 3-oxoacyl-acp reductase (fabg) from acinetobacter baumannii

6UDS · 3-oxoacyl-(acyl-carrier-protein) reductase: “Crystal structure of a putative 3-oxoacyl-acp reductase (fabg) from acinetobacter baumannii”. X-ray diffraction, 3 pockets (best druggability 0.68). MolNFT v1 #166029 on GenesisL1: 3D…

PDB: 6UDS
Type: protein
Length: 484 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: 3-oxoacyl-(acyl-carrier-protein) reductase
EC: 1.1.1.100
UniProt: V5VHN7
Pockets: 3 · best druggability 0.68

Structure

x-ray diffraction · 2 distinct chains · 53% helix, 17% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	3-oxoacyl-(acyl-carrier-protein) reductase (EC 1.1.1.100)	protein	244	52% helix, 17% strand	V5VHN7
B	3-oxoacyl-(acyl-carrier-protein) reductase (EC 1.1.1.100)	protein	240	53% helix, 17% strand	V5VHN7

Pockets

3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	545	0.68	0.78	47	empty
2	451	0.65	0.78	48	empty
3	110	0.37	0.75	20	empty

Interfaces

1 interface between chains.

A–B · 1554 Å² buried · 20 hydrogen bonds · protein-protein

Compared structures

6UDS · Crystal structure of a putative 3-oxoacyl-ACP reductase (FabG) from Acinetobacter… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt V5VHN7
Elsewhere: RCSB PDB 6UDS · PDBe 6UDS · UniProt V5VHN7

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